In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 34 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 6.25 | 11.42 | -10.79 | 2 | 5 | 0 | 69 | 475.951 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.25 | 12.19 | -47.95 | 1 | 5 | -1 | 72 | 474.943 | 5 | ↓ |